| SpectraBase Spectrum ID |
28UWEZzCBrf |
| Name |
2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-3-keto-butyric acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.132136366 u |
| Formula |
C16H20N2O6 |
| InChI |
InChI=1S/C16H20N2O6/c1-10(14(20)18-13(11(2)19)15(21)23-3)17-16(22)24-9-12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3,(H,17,22)(H,18,20)/t10-,13?/m0/s1 |
| InChIKey |
GMNWUALIFRNKRF-NKUHCKNESA-N |
| Molecular Weight |
336.344 g/mol |
| SMILES |
C(NC([C@@](NC(=O)OCC=1C=CC=CC1)(C)[H])=O)(C(=O)OC)C(=O)C |
![2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-3-keto-butyric acid methyl ester](/api/spectrum/28UWEZzCBrf/structure.png?h=300&w=458 "2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-3-keto-butyric acid methyl ester")
